Reaction Details |
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Target | C-8 sterol isomerase ERG2 |
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Ligand | BDBM50170653 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_303390 (CHEMBL839961) |
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Ki | >100000±n/a nM |
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Citation | Laggner, C; Schieferer, C; Fiechtner, B; Poles, G; Hoffmann, RD; Glossmann, H; Langer, T; Moebius, FF Discovery of high-affinity ligands of sigma1 receptor, ERG2, and emopamil binding protein by pharmacophore modeling and virtual screening. J Med Chem48:4754-64 (2005) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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C-8 sterol isomerase ERG2 |
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Name: | C-8 sterol isomerase ERG2 |
Synonyms: | C-8 sterol isomerase | Delta-8--delta-7 sterol isomerase | ERG2 | ERG2_YEAST |
Type: | PROTEIN |
Mol. Mass.: | 24892.29 |
Organism: | Saccharomyces cerevisiae |
Description: | ChEMBL_303390 |
Residue: | 222 |
Sequence: | MKFFPLLLLIGVVGYIMNVLFTTWLPTNYMFDPKTLNEICNSVISKHNAAEGLSTEDLLQ
DVRDALASHYGDEYINRYVKEEWVFNNAGGAMGQMIILHASVSEYLILFGTAVGTEGHTG
VHFADDYFTILHGTQIAALPYATEAEVYTPGMTHHLKKGYAKQYSMPGGSFALELAQGWI
PCMLPFGFLDTFSSTLDLYTLYRTVYLTARDMGKNLLQNKKF
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BDBM50170653 |
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n/a |
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Name | BDBM50170653 |
Synonyms: | (11beta)-11,21-dihydroxypregn-4-ene-3,20-dione | 11beta,21-dihydroxypregn-4-ene-3,20-dione | 11beta,21-dihydroxyprogesterone | 17-deoxycortisol | CHEMBL110739 | corticosterone |
Type | Small organic molecule |
Emp. Form. | C21H30O4 |
Mol. Mass. | 346.4605 |
SMILES | C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO |r,t:9| |
Structure |
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